SCHEMBL3759040

SCHEMBL3759040

CCN(CC)C(=O)c1ccccc1-c1cc(-c2c(N3CCOCC3)sc3c2CC(C)(C)CC3=O)ccn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.36
BUB1 O43683 2/20 0.35
GABRA1 P14867 2/20 0.35
GABRG2 P18507 2/20 0.35
GABRB3 P28472 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRA3 P34903 2/20 0.35
GABRA2 P47869 2/20 0.35
ALDH1A1 P00352 2/20 0.35
PIK3CA P42336 3/20 0.33
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CG P48736 2/20 0.33
KEAP1 Q14145 1/20 0.33
NPSR1 Q6W5P4 4/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
JMJD6 Q6NYC1 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3758763 0.89 BUB1 (0.41) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3767645 0.88 ALDH1A1 (0.38) BUB1GABRA1GABRG2GABRB3GABRA5
SCHEMBL3770917 0.88 ALOX5AP (0.40) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3762256 0.86 BRD4 (0.40) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3765618 0.84 BRD4 (0.42) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3765702 0.84 BRD4 (0.40) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3765731 0.83 CYP1A2 (0.42) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3765073 0.83 LRRK2 (0.42) BRD4BUB1GABRA1GABRG2GABRB3
SCHEMBL3761442 0.83 MTOR (0.38) BUB1GABRA1GABRG2GABRB3GABRA5
SCHEMBL3763693 0.82 GABRA1 (0.48) BRD4BUB1GABRA1GABRG2GABRB3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA BRD4 1041/4885BUB1 565/4885GABRA1 4302/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.